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SMILES: CC(C)COC(=O)c1ccccc1NCC1=NCCN1

InChI Key: InChIKey=CBLUHSHTFYFAED-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50219130   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50219130
PNG
(CHEMBL95398)
Show SMILES CC(C)COC(=O)c1ccccc1NCC1=NCCN1 |t:16|
Show InChI InChI=1S/C15H21N3O2/c1-11(2)10-20-15(19)12-5-3-4-6-13(12)18-9-14-16-7-8-17-14/h3-6,11,18H,7-10H2,1-2H3,(H,16,17)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 79n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Potency against cloned human alpha 1B adrenoceptor expressed in rat-1 fibroblasts.


Bioorg Med Chem Lett 11: 2871-4 (2001)


BindingDB Entry DOI: 10.7270/Q2CC1201
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50219130
PNG
(CHEMBL95398)
Show SMILES CC(C)COC(=O)c1ccccc1NCC1=NCCN1 |t:16|
Show InChI InChI=1S/C15H21N3O2/c1-11(2)10-20-15(19)12-5-3-4-6-13(12)18-9-14-16-7-8-17-14/h3-6,11,18H,7-10H2,1-2H3,(H,16,17)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 251n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Potency against cloned human alpha 1D-adrenoceptor expressed in rat-1 fibroblasts.


Bioorg Med Chem Lett 11: 2871-4 (2001)


BindingDB Entry DOI: 10.7270/Q2CC1201
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50219130
PNG
(CHEMBL95398)
Show SMILES CC(C)COC(=O)c1ccccc1NCC1=NCCN1 |t:16|
Show InChI InChI=1S/C15H21N3O2/c1-11(2)10-20-15(19)12-5-3-4-6-13(12)18-9-14-16-7-8-17-14/h3-6,11,18H,7-10H2,1-2H3,(H,16,17)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 501n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist potency against cloned human alpha 1A adrenoceptor expressed in rat-1 fibroblasts.


Bioorg Med Chem Lett 11: 2871-4 (2001)


BindingDB Entry DOI: 10.7270/Q2CC1201
More data for this
Ligand-Target Pair